Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.53 |
| ▸ | MCOLN3 | Q8TDD5 | 1/20 | 0.47 |
| ▸ | BIRC5 | O15392 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | DRD2 | P14416 | 1/20 | 0.41 |
| ▸ | DRD1 | P21728 | 1/20 | 0.41 |
| ▸ | DRD3 | P35462 | 1/20 | 0.41 |
| ▸ | HSP90AB1 | P08238 | 2/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | KDR | P35968 | 1/20 | 0.39 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL13602317 | 0.87 | KDM4E (0.53) | KDM4EMCOLN3BIRC5SMN1; SMN2SIGMAR1 | |
| SCHEMBL13696489 | 0.83 | KDM4E (0.49) | KDM4EMCOLN3SMN1; SMN2ALDH1A1TDP1 | |
| SCHEMBL13648205 | 0.83 | KDM4E (0.49) | KDM4EMCOLN3BIRC5SMN1; SMN2SIGMAR1 | |
| SCHEMBL2564475 | 0.82 | KDM4E (0.44) | KDM4EBIRC5SMN1; SMN2SIGMAR1ALDH1A1 | |
| SCHEMBL1755246 | 0.80 | MCOLN3 (0.56) | KDM4EMCOLN3SMN1; SMN2ALDH1A1MAPT | |
| SCHEMBL14421841 | 0.79 | MCOLN3 (0.48) | MCOLN3SMN1; SMN2ALDH1A1TDP1MAPT | |
| SCHEMBL11207045 | 0.79 | KDM4E (0.44) | KDM4EBIRC5SMN1; SMN2SIGMAR1ALDH1A1 | |
| SCHEMBL31222300 | 0.77 | MAPT (0.40) | MCOLN3SMN1; SMN2ALDH1A1MAPTTSHR | |
| SCHEMBL13648163 | 0.77 | S1PR4 (0.44) | KDM4EMCOLN3BIRC5SMN1; SMN2ALDH1A1 | |
| SCHEMBL7940396 | 0.77 | HPGD (0.57) | KDM4EBIRC5SMN1; SMN2ALDH1A1MAPT |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20090215777-A1 | Pyrimidine Derivatives As HSP90 Inhibitors | ASTEX THERAPEUTICS LTD. (GB) | 2009-08-27 | — | — | US | disclosed |
Patent text — is the patent's own abstract consistent with the prediction?
For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.
| Patent | Title | Text reads most about | Predicted target · text-rank |
|---|---|---|---|
| US-20090215777-A1 | Pyrimidine Derivatives As HSP90 Inhibitors | HSP90AB1, HSP90AB2P, HSP90B1 | KDM4E 4124/4885MCOLN3 3189/4885BIRC5 810/4885 |
“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.